Compound Identification
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.[2H]C([2H])([2H])C([2H])(N(CCC(C(N)=O)(C1=CC=CC=C1)C1=CC=CC=N1)C([2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])C([2H])([2H])[2H]
InChIKey
InChIKey=GDBCAFSQSJLIBR-HHJIGIPXSA-N
Formula
C28H37N3O4S
Mass
525.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass Pheniramines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pheniramines
Intermediate Tree Nodes
Not available
Direct Parent
Pheniramines
Alternative Parents
p-Methylbenzenesulfonates Tosyl compounds Phenylacetamides 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Aralkylamines Fatty amides Sulfonyls Organosulfonic acids Heteroaromatic compounds Trialkylamines Amino acids and derivatives Primary carboxylic acid amides Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Pheniramine - P-methylbenzenesulfonate - Benzenesulfonate - Tosyl compound - Phenylacetamide - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Toluene - Aralkylamine - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - Organosulfonic acid - Heteroaromatic compound - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Amine - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pheniramines. These are compounds containing a pheniramine moiety, which is structurally characterized by the presence of a 2-benzylpyridine linked to an dimethyl(propyl)amine to form a dimethyl[3-phenyl-3-(pyridin-2-yl)propyl]amine skeleton.
External Descriptors
Not available